PUBCHEM-ZINC05224641 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.3190 2.2890 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 0.9900 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 0.1930 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 0.6830 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 1.9960 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 2.7910 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -0.2000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5190 -1.1980 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -0.3830 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -1.2400 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -1.3040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.5730 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 -0.6600 2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 0.3400 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 -2.3040 0.2370 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 -1.8360 -2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 -2.5090 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -2.9800 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -3.6050 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -3.7780 -5.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -3.3430 -5.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -2.7180 -4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -2.3040 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 -1.9020 -3.5470 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5690 2.9090 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 0.5970 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -0.8160 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.4160 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 3.8040 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -0.7880 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 0.5860 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 1.3410 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 0.4020 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 -1.8080 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -2.8970 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -3.9640 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 -4.2630 -6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 -3.4980 -6.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5560 -2.3960 -5.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 2 0 0 0 0 M CHG 1 24 -1 M END